Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7373367 | 0.84 | MMP2 (0.54) | ALDH1A1SLC6A2SLC6A3KMT2ATDP1 | |
| SCHEMBL7300508 | 0.84 | MMP2 (0.56) | ALDH1A1SLC6A2SLC6A3KMT2ATDP1 | |
| SCHEMBL23978728 | 0.83 | BCAT2 (0.49) | ALDH1A1BCAT2SLC6A2SLC6A3KMT2A | |
| SCHEMBL27690076 | 0.83 | ALDH1A1 (0.53) | ALDH1A1SLC6A2SLC6A3KMT2ATDP1 | |
| SCHEMBL7113323 | 0.81 | LMNA (0.54) | LMNASMN1; SMN2ATMCA12CA1 | |
| SCHEMBL27887667 | 0.79 | CA2 (0.51) | ALDH1A1SLC6A2SLC6A3KMT2ATDP1 | |
| SCHEMBL12150014 | 0.79 | HSD17B10 (0.58) | L3MBTL1MAPTLMNASMN1; SMN2CTSB | |
| SCHEMBL23978669 | 0.79 | MEN1 (0.50) | ALDH1A1KMT2AMAPTLMNACA12 | |
| SCHEMBL7368912 | 0.79 | ALDH1A1 (0.56) | ALDH1A1SLC6A2SLC6A3KMT2ATDP1 | |
| SCHEMBL7350146 | 0.79 | ALDH1A1 (0.56) | ALDH1A1SLC6A2SLC6A3KMT2ATDP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021222789-A1 | INHIBITORS OF ALPHA 2 BETA 1 INTEGRIN AND METHODS OF USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-11-04 | — | — | WO | disclosed |